Information card for entry 8106006

Structure parameters

• Chemical name: N-(adamantan-1-yl)-5-(dimethylamino)naphthalene-1-sulfonamide
• Formula: C22 H28 N2 O2 S
• Calculated formula: C22 H28 N2 O2 S
• Title of publication: Crystal structure of N-(adamantan-1-yl)-5-(dimethylamino)naphthalene-1-sulfonamide, C22H28N2O2S
• Authors of publication: Joubert, Jacques
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 234
• Journal issue: 6
• Pages of publication: 1279 - 1281
• a: 9.2516 ± 0.0007 Å
• b: 10.5122 ± 0.0008 Å
• c: 19.7782 ± 0.0015 Å
• α: 90°
• β: 98.953 ± 0.001°
• γ: 90°
• Cell volume: 1900.1 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0406
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0966
• Weighted residual factors for all reflections included in the refinement: 0.1004
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No